SCHEMBL12154151

SCHEMBL12154151

CCC1CCC(C(=O)Oc2ccc(C)cc2)CC1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.54
KMT2A Q03164 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
F2 P00734 1/20 0.49
ELANE P08246 2/20 0.49
LMNA P02545 1/20 0.44
POLB P06746 1/20 0.42
ALDH1A1 P00352 2/20 0.42
HPGD P15428 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
TSHR P16473 1/20 0.41
CHRNA7 P36544 1/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL11408190 0.96 HTT (0.50) HTTKMT2ASMN1; SMN2TDP1F2
SCHEMBL12154218 0.94 KMT2A (0.61) HTTKMT2ASMN1; SMN2TDP1F2
SCHEMBL20045170 0.94 KMT2A (0.61) HTTKMT2ASMN1; SMN2TDP1F2
SCHEMBL24605352 0.88 KMT2A (0.68) HTTKMT2ASMN1; SMN2TDP1F2
SCHEMBL27947111 0.88 KMT2A (0.68) HTTKMT2ASMN1; SMN2TDP1F2
SCHEMBL12370833 0.88 KMT2A (0.68) HTTKMT2ASMN1; SMN2TDP1F2
SCHEMBL2741099 0.88 KMT2A (0.68) HTTKMT2ASMN1; SMN2TDP1F2
SCHEMBL12012965 0.88 KMT2A (0.51) HTTKMT2ASMN1; SMN2TDP1F2
SCHEMBL17059002 0.88 KMT2A (0.54) HTTKMT2ASMN1; SMN2TDP1F2
SCHEMBL20443893 0.88 KMT2A (0.54) HTTKMT2ASMN1; SMN2TDP1F2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120274888-A1 OPTICALLY ANISOTROPIC SUBSTANCE JNC PETROCHEMICAL CORPORATION (JP) 2012-11-01 US disclosed
US-8048496-B2 Polymerizable liquid crystal compound, liquid crystal composition and polymer JNC CORPORATION (JP) 2011-11-01 US disclosed
US-20100297367-A1 OPTICALLY ANISOTROPIC SUBSTANCE CHISSO CORPORATION (JP) 2010-11-25 US disclosed
US-20100096591-A1 POLYMERIZABLE LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND POLYMER CHISSO CORPORATION 2010-04-22 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100096591-A1 POLYMERIZABLE LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND POLYMER PKN1, ZYX, OXER1 HTT 3468/4885KMT2A 1370/4885SMN1; SMN2 3040/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.